2-(6-Methylpyridin-3-yl)acetic acid - CAS 19733-96-1
Catalog: |
BB015245 |
Product Name: |
2-(6-Methylpyridin-3-yl)acetic acid |
CAS: |
19733-96-1 |
Synonyms: |
2-(6-methyl-3-pyridinyl)acetic acid; 2-(6-methylpyridin-3-yl)acetic acid |
IUPAC Name: | 2-(6-methylpyridin-3-yl)acetic acid |
Description: | 2-(6-Methylpyridin-3-yl)acetic acid (CAS# 19733-96-1) is a useful research chemical. |
Molecular Weight: | 151.16 |
Molecular Formula: | C8H9NO2 |
Canonical SMILES: | CC1=NC=C(C=C1)CC(=O)O |
InChI: | InChI=1S/C8H9NO2/c1-6-2-3-7(5-9-6)4-8(10)11/h2-3,5H,4H2,1H3,(H,10,11) |
InChI Key: | DWTRPWLHNATUPX-UHFFFAOYSA-N |
Boiling Point: | 298.721 °C at 760 mmHg |
Density: | 1.196 g/cm3 |
Appearance: | Solid |
MDL: | MFCD00190601 |
LogP: | 1.01710 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020148705-A1 | Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein | 20181109 |
WO-2020097577-A1 | Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (mcl-1) protein | 20181109 |
CN-113166173-A | Spiro-sulfonamide derivatives as inhibitors of myeloid leukemia 1(MCL-1) protein | 20181109 |
EP-3877390-A1 | Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (mcl-1) protein | 20181109 |
KR-20210089662-A | Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein | 20181109 |
Complexity: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 151.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.06332853 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 50.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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